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CHEBI:116742 - 6-amino-3-(methoxymethyl)-5-spiro[2H-pyrano[2,3-c]pyrazole-4,4'-thiane]carbonitrile
| Formula | C13H16N4O2S |
| Net Charge | 0 |
| Average Mass | 292.364 |
| Monoisotopic Mass | 292.09940 |
| SMILES | COCc1nnc2c1C1(CCSCC1)C(C#N)=C(N)O2 |
| InChI | InChI=1S/C13H16N4O2S/c1-18-7-9-10-12(17-16-9)19-11(15)8(6-14)13(10)2-4-20-5-3-13/h2-5,7,15H2,1H3,(H,16,17) |
| InChIKey | WNXWUQRVNFZHIJ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 6-amino-3-(methoxymethyl)-5-spiro[2H-pyrano[2,3-c]pyrazole-4,4'-thiane]carbonitrile (CHEBI:116742) is a nitrile (CHEBI:18379) |
| 6-amino-3-(methoxymethyl)-5-spiro[2H-pyrano[2,3-c]pyrazole-4,4'-thiane]carbonitrile (CHEBI:116742) is a organic sulfide (CHEBI:16385) |
| 6-amino-3-(methoxymethyl)-5-spiro[2H-pyrano[2,3-c]pyrazole-4,4'-thiane]carbonitrile (CHEBI:116742) is a organosulfur heterocyclic compound (CHEBI:38106) |
| 6-amino-3-(methoxymethyl)-5-spiro[2H-pyrano[2,3-c]pyrazole-4,4'-thiane]carbonitrile (CHEBI:116742) is a oxaspiro compound (CHEBI:37948) |
| IUPAC Name |
|---|
| 6-amino-3-(methoxymethyl)-2',3',5',6'-tetrahydro-2H-spiro[pyrano[2,3-c]pyrazole-4,4'-thiopyran]-5-carbonitrile |
| Synonym | Source |
|---|---|
| BRD-K34394171 | ChEBI |
| Manual Xrefs | Databases |
|---|---|
| LSM-28194 | LINCS |